2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide

C6H10N4O2 — CID 79959649

IUPAC2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide
SMILESCNC(=O)CC1NC(=O)N=C1N
InChIInChI=1S/C6H10N4O2/c1-8-4(11)2-3-5(7)10-6(12)9-3/h3H,2H2,1H3,(H,8,11)(H3,7,9,10,12)
InChIKeyFIBJGXCEEMPEJC-UHFFFAOYSA-N
MW170.17 g/mol
LogP-1.43
Rot. Bonds2

About 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide

2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide (PubChem CID 79959649) has the molecular formula C6H10N4O2 and a molecular weight of 170.17 g/mol. Its IUPAC name is 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide
PubChem CID79959649
Molecular FormulaC6H10N4O2
Molecular Weight170.17 g/mol
Exact Mass170.08
IUPAC Name2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide
SMILESCNC(=O)CC1NC(=O)N=C1N
InChIInChI=1S/C6H10N4O2/c1-8-4(11)2-3-5(7)10-6(12)9-3/h3H,2H2,1H3,(H,8,11)(H3,7,9,10,12)
InChIKeyFIBJGXCEEMPEJC-UHFFFAOYSA-N
XLogP-1.43
TPSA96.58 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-1.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide?
The IUPAC name of 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide (CID 79959649) is 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide.
What is the SMILES notation for 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide?
The canonical SMILES for 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide is CNC(=O)CC1NC(=O)N=C1N.
What is the InChIKey of 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide?
The InChIKey is FIBJGXCEEMPEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2/c1-8-4(11)2-3-5(7)10-6(12)9-3/h3H,2H2,1H3,(H,8,11)(H3,7,9,10,12).
What are the key properties of 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide?
2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide has a molecular weight of 170.17 g/mol, XLogP of -1.43, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2-oxo-1,5-dihydroimidazol-5-yl)-N-methylacetamide is sourced from PubChem (CID 79959649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).